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1087784-79-9 | N-pentyl-1H-imidazole-1-carboxamide
CAS No: 1087784-79-9 Catalog No: AG019QPM MDL No:MFCD11099674
Product Description
Catalog Number:
AG019QPM
Chemical Name:
N-pentyl-1H-imidazole-1-carboxamide
CAS Number:
1087784-79-9
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
MDL Number:
MFCD11099674
IUPAC Name:
N-pentylimidazole-1-carboxamide
InChI:
InChI=1S/C9H15N3O/c1-2-3-4-5-11-9(13)12-7-6-10-8-12/h6-8H,2-5H2,1H3,(H,11,13)
InChI Key:
MOEGSHGOAYPMPB-UHFFFAOYSA-N
SMILES:
CCCCCNC(=O)n1cncc1
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.122g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.239g/mol
Monoisotopic Mass:
181.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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